N-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide

C15H9Cl2FN2OS2 — CID 8670631

IUPACN-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide
SMILESO=C(Cc1ccc(F)cc1)Nc1nc(-c2cc(Cl)sc2Cl)cs1
InChIInChI=1S/C15H9Cl2FN2OS2/c16-12-6-10(14(17)23-12)11-7-22-15(19-11)20-13(21)5-8-1-3-9(18)4-2-8/h1-4,6-7H,5H2,(H,19,20,21)
InChIKeyMBQSUJVULBGEMN-UHFFFAOYSA-N
MW387.29 g/mol
LogP5.50
Rot. Bonds4

About N-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide

N-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide (PubChem CID 8670631) has the molecular formula C15H9Cl2FN2OS2 and a molecular weight of 387.29 g/mol. Its IUPAC name is N-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide
PubChem CID8670631
Molecular FormulaC15H9Cl2FN2OS2
Molecular Weight387.29 g/mol
Exact Mass385.95
IUPAC NameN-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide
SMILESO=C(Cc1ccc(F)cc1)Nc1nc(-c2cc(Cl)sc2Cl)cs1
InChIInChI=1S/C15H9Cl2FN2OS2/c16-12-6-10(14(17)23-12)11-7-22-15(19-11)20-13(21)5-8-1-3-9(18)4-2-8/h1-4,6-7H,5H2,(H,19,20,21)
InChIKeyMBQSUJVULBGEMN-UHFFFAOYSA-N
XLogP5.50
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.29
LogP ≤ 55.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide?
The IUPAC name of N-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide (CID 8670631) is N-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide.
What is the SMILES notation for N-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide?
The canonical SMILES for N-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide is O=C(Cc1ccc(F)cc1)Nc1nc(-c2cc(Cl)sc2Cl)cs1.
What is the InChIKey of N-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide?
The InChIKey is MBQSUJVULBGEMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl2FN2OS2/c16-12-6-10(14(17)23-12)11-7-22-15(19-11)20-13(21)5-8-1-3-9(18)4-2-8/h1-4,6-7H,5H2,(H,19,20,21).
What are the key properties of N-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide?
N-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide has a molecular weight of 387.29 g/mol, XLogP of 5.50, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,5-dichlorothiophen-3-yl)-1,3-thiazol-2-yl]-2-(4-fluorophenyl)acetamide is sourced from PubChem (CID 8670631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).